Vitas-M small molecule compound
ethyl 4-hydroxy-2-[5-(2-methyl-4-nitrophenyl)furan-2-yl]-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK383765
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(o1)c1ccc(cc1C)[N+](=O)[O-])O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H22N4O6S MW 482.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O6S/c1-3-32-23(29)26-9-8-15-18(11-26)34-22-19(15)21(28)24-20(25-22)17-7-6-16(33-17)14-5-4-13(27(30)31)10-12(14)2/h4-7,10,20,25H,3,8-9,11H2,1-2H3,(H,24,28)InChIKey
UDXLITNQHGEUHW-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(O4)C5=C(C=C(C=C5)(N+)(=O)(O))C
CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(o1)c1ccc(cc1C)(N+)(=O)(O))O
ethyl2(5(2methyl4nitrophenyl)furan2yl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
ethyl4hydroxy2(5(2methyl4nitrophenyl)furan2yl)1568tetrahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
InChI=1SC23H22N4O6Sc133223(29)26981518(1126)342219(15)21(28)2420(2522)177616(3317)145413(27(30)31)1012(14)2h47102025H38911H212H3(H2428)
MFCD11853247
ZINC000008921693
ZINC000008921697
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